Geometry & MOs

Info

ID:	334640
PubChem CID:	127253315
Reduced:	N2O2C11H14 (3)
Stoich.:	A2B2C11D14 (3)
Weight, g/mol:	427.141973
ΔH_f, kcal/mol:	-115.8
Dipole, Da:	11.2
IP(EA), eV:	-8.34(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-6-[(4-methoxyphenyl)methyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CC[C@@H](C)[C@@H](C(=O)NCCNC1=NC=CC=N1)NC2=CC=C3C(=CC2=O)[C@H](CCC4=CC(=C(C(=C43)OC)OC)OC)NC(=O)C

DOS

IR

Vibrations